N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide

C16H19N3O3 — CID 119515767

IUPACN-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide
SMILESCOCCCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1
InChIInChI=1S/C16H19N3O3/c1-21-9-2-10-22-14-6-3-12(4-7-14)16(20)19-13-5-8-15(17)18-11-13/h3-8,11H,2,9-10H2,1H3,(H2,17,18)(H,19,20)
InChIKeyKLCNOPPAKCMMIA-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.33
Rot. Bonds7

About N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide

N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide (PubChem CID 119515767) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide
PubChem CID119515767
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide
SMILESCOCCCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1
InChIInChI=1S/C16H19N3O3/c1-21-9-2-10-22-14-6-3-12(4-7-14)16(20)19-13-5-8-15(17)18-11-13/h3-8,11H,2,9-10H2,1H3,(H2,17,18)(H,19,20)
InChIKeyKLCNOPPAKCMMIA-UHFFFAOYSA-N
XLogP2.33
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
CID 119516313
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
4-butoxy-N-(6-methoxy-3-pyridinyl)benzamide
CID 7478576
N-(6-amino-3-pyridinyl)-4-hydroxybenzamide
CID 62900503
4-butoxy-N-(6-chloro-3-pyridinyl)benzamide
CID 54787952
N-(6-amino-3-pyridinyl)-4-iodobenzamide
CID 55132398
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168
methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]benzoate
CID 17178280
4-methoxy-N-[6-[2-(4-methoxyphenoxy)ethylamino]-3-pyridinyl]benzamide
CID 113014697
4-[4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]phenoxy]benzamide
CID 56545946
4-(2-methoxyethoxy)-N-phenylbenzamide
CID 15943269
N-[4-(2-methoxyethoxy)phenyl]-4-(methoxymethyl)benzamide
CID 46441939

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide (CID 119515767) is N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide is COCCCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide?
The InChIKey is KLCNOPPAKCMMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-21-9-2-10-22-14-6-3-12(4-7-14)16(20)19-13-5-8-15(17)18-11-13/h3-8,11H,2,9-10H2,1H3,(H2,17,18)(H,19,20).
What are the key properties of N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide?
N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide has a molecular weight of 301.35 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide is sourced from PubChem (CID 119515767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).